Geometry & MOs

Info

ID:	279761
PubChem CID:	103845053
Reduced:	O2N4C17H30 (1)
Stoich.:	A2B4C17D30 (1)
Weight, g/mol:	322.063968
ΔH_f, kcal/mol:	-88.08
Dipole, Da:	2.68
IP(EA), eV:	-9.23(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2,5-dichlorophenyl)methylamino]phenyl]propanamide

Drug info:

PubChemData

Smile

CCN1C(=CC=N1)CNC2CCCCN(C2)C(=O)OC(C)(C)C

DOS

IR

Vibrations