Geometry & MOs

Info

ID:	74508
PubChem CID:	48421977
Reduced:	N3O4C14H21 (1)
Stoich.:	A3B4C14D21 (1)
Weight, g/mol:	382.200491
ΔH_f, kcal/mol:	-96.04
Dipole, Da:	8.34
IP(EA), eV:	-9.52(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-[4-(pyridin-2-ylmethyl)piperazin-1-yl]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)CN(C)C(=O)C(C)OCC2CC2

DOS

IR

Vibrations