Geometry & MOs

Info

ID:	129845
PubChem CID:	51074028
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	337.179027
ΔH_f, kcal/mol:	-81.89
Dipole, Da:	1.45
IP(EA), eV:	-9.09(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[[(4-methylphenyl)-phenylmethyl]amino]acetyl]piperazin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C(C)NCC(=O)N2CCNC(=O)C2

DOS

IR

Vibrations