Geometry & MOs

Info

ID:	251369
PubChem CID:	103103469
Reduced:	N3O4C7H13 (1)
Stoich.:	A3B4C7D13 (1)
Weight, g/mol:	299.067284
ΔH_f, kcal/mol:	-179.68
Dipole, Da:	4.7
IP(EA), eV:	-9.81(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2-amino-2-oxoethyl)-ethylcarbamoyl]amino]-5-chlorobenzoic acid

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)NCC(=O)O

DOS

IR

Vibrations