Geometry & MOs

Info

ID:

376647

PubChem CID:

134222668

Reduced:

SO3N4C30H36 (1)

Stoich.:

AB3C4D30E36 (1)

Weight, g/mol:

522.299476

ΔHf, kcal/mol:

-55.57

Dipole, Da:

1.61

IP(EA), eV:

 -8.91(-0.91)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-methyl-N-[4-[2-[[6-[4-(1-methylcyclopropyl)phenyl]-5-phenylpyridazin-3-yl]amino]-2-oxoethyl]cyclohexyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC1(CCC1)C2=CC=C(C=C2)C3=NN=C(C=C3C4=CSC=C4)NC(=O)CC5CCC(CC5)N(C)C(=O)OC

DOS

IR

Vibrations