Geometry & MOs

Info

ID:	69872
PubChem CID:	47205661
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	282.113506
ΔH_f, kcal/mol:	-95.46
Dipole, Da:	1.23
IP(EA), eV:	-9.42(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[1-(2-chlorophenyl)ethylamino]-2-oxoethyl]butanamide

Drug info:

PubChemData

Smile

CCCC(=O)NCC(=O)NC1CCCC2=CC=CC=C12

DOS

IR

Vibrations