Geometry & MOs

Info

ID:	28407
PubChem CID:	827414
Reduced:	ClON6C10H17 (1)
Stoich.:	ABC6D10E17 (1)
Weight, g/mol:	253.110279
ΔH_f, kcal/mol:	-4.51
Dipole, Da:	2.87
IP(EA), eV:	-9.46(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzoyl-N-ethylbenzamide

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=N1)Cl)N(C(C)C)NC(=O)C

DOS

IR

Vibrations