Geometry & MOs

Info

ID:	126943
PubChem CID:	50984732
Reduced:	O2N5C22H25 (1)
Stoich.:	A2B5C22D25 (1)
Weight, g/mol:	360.135304
ΔH_f, kcal/mol:	-28.96
Dipole, Da:	6.76
IP(EA), eV:	-8.7(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-chlorophenoxy)piperidin-4-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=CC=C1NC(=O)CN2CCCC(C2)C3=NC4=CC=CC=C4N3

DOS

IR

Vibrations