Geometry & MOs

Info

ID:	183971
PubChem CID:	77096492
Reduced:	N3C19H25 (1)
Stoich.:	A3B19C25 (1)
Weight, g/mol:	319.154544
ΔH_f, kcal/mol:	43.39
Dipole, Da:	2.24
IP(EA), eV:	-8.98(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1H-benzimidazol-2-ylmethyl)-2-(1H-pyrazol-4-yl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

Drug info:

PubChemData

Smile

CCC1=NC=CC(=N1)CN2CCCC(CC2)C3=CC=CC=C3

DOS

IR

Vibrations