Geometry & MOs

Info

ID:	49341
PubChem CID:	11532875
Reduced:	N2O2C13H18 (2)
Stoich.:	A2B2C13D18 (2)
Weight, g/mol:	468.288912
ΔH_f, kcal/mol:	-175.89
Dipole, Da:	6.48
IP(EA), eV:	-8.69(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzhydryl-4-[(1-phenylpiperidin-4-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C2=CC=CC=C2C=C(C1=O)C(=O)NCC3C[C@H]4CC[C@@H](C3)N4CC(CNC(=O)C)O

DOS

IR

Vibrations