Geometry & MOs

Info

ID:	425550
PubChem CID:	135126682
Reduced:	ClON7C16H16 (1)
Stoich.:	ABC7D16E16 (1)
Weight, g/mol:	420.202222
ΔH_f, kcal/mol:	60.39
Dipole, Da:	6.73
IP(EA), eV:	-9.12(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(cyclopropanecarbonylamino)-4-[3-(1,5-dimethyl-1,2,4-triazol-3-yl)-2-methylanilino]-N-methylpyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC2=CC(=NN=C2C(=O)NC)Cl)C3=NNC(=N3)C

DOS

IR

Vibrations