Geometry & MOs

Info

ID:	376648
PubChem CID:	134222669
Reduced:	O2N4C33H38 (1)
Stoich.:	A2B4C33D38 (1)
Weight, g/mol:	539.326026
ΔH_f, kcal/mol:	13.99
Dipole, Da:	2.11
IP(EA), eV:	-9.01(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-[[6-[4-(1-amino-3-methylcyclobutyl)phenyl]-5-phenylpyridazin-3-yl]amino]-2-oxoethyl]cyclohexyl]-N-methylpropanamide

Drug info:

PubChemData

Smile

CC1(CC1)C2=CC=C(C=C2)C3=NN=C(C=C3C4=CC=CC=C4)NC(=O)CC5CCC(CC5)N(C)C(=O)C6CC6

DOS

IR

Vibrations