Geometry & MOs

Info

ID:	13993
PubChem CID:	401355
Reduced:	N3O3C25H25 (1)
Stoich.:	A3B3C25D25 (1)
Weight, g/mol:	415.189592
ΔH_f, kcal/mol:	-32.9
Dipole, Da:	5.39
IP(EA), eV:	-8.46(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methoxybenzoyl)-N,4-diphenylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)N(C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

DOS

IR

Vibrations