Geometry & MOs

Info

ID:	172150
PubChem CID:	75472638
Reduced:	SN2O2C15H20 (1)
Stoich.:	AB2C2D15E20 (1)
Weight, g/mol:	398.185509
ΔH_f, kcal/mol:	-80.59
Dipole, Da:	4.29
IP(EA), eV:	-8.79(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-imidazol-1-ylpyridin-3-yl)methyl]-3-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide

Drug info:

PubChemData

Smile

CC(C)[C@H]1C(=O)N(C(=O)N1)CC(C)SC2=CC=CC=C2

DOS

IR

Vibrations