Geometry & MOs

Info

ID:	426277
PubChem CID:	135143158
Reduced:	OSN2C18H23 (2)
Stoich.:	ABC2D18E23 (2)
Weight, g/mol:	272.163711
ΔH_f, kcal/mol:	2.37
Dipole, Da:	4.14
IP(EA), eV:	-8.06(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-6-methyl-7-[(Z)-prop-1-enyl]-3H-imidazo[4,5-c]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCNC1=C(C(=C(C=C1)C(C2=CC(=C(S2)C)CN3CCCC4=CC=CC=C4S3=O)C(C)(C)C(=O)N/C(=C/C=C\C)/C=C)C)N

DOS

IR

Vibrations