Geometry & MOs

Info

ID:	429356
PubChem CID:	135169370
Reduced:	SO4N5C22H27 (1)
Stoich.:	AB4C5D22E27 (1)
Weight, g/mol:	137.095297
ΔH_f, kcal/mol:	-105.3
Dipole, Da:	3.41
IP(EA), eV:	-8.24(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4,5,6,7-tetrahydro-2H-imidazo[4,5-c]pyridine

Drug info:

PubChemData

Smile

CNC(=O)NC1=NC=CC(=C1)COC2=CC(=C3C(=C2)SC(=N3)NC4CCCC[C@@H]4O)OC

DOS

IR

Vibrations