Geometry & MOs

Info

ID:	235125
PubChem CID:	92304083
Reduced:	FSN2O2H17C22 (1)
Stoich.:	ABC2D2E17F22 (1)
Weight, g/mol:	350.154289
ΔH_f, kcal/mol:	-47.15
Dipole, Da:	3.31
IP(EA), eV:	-9.13(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,6R)-N-benzyl-4-(4-fluorophenyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-6-carboxamide

Drug info:

PubChemData

Smile

C1C(=O)N([C@@H](S1)C2=CC=CC=C2NC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)F

DOS

IR

Vibrations