Geometry & MOs

Info

ID:	258724
PubChem CID:	103156619
Reduced:	N2O3C9H20 (1)
Stoich.:	A2B3C9D20 (1)
Weight, g/mol:	301.082934
ΔH_f, kcal/mol:	-147.78
Dipole, Da:	3.65
IP(EA), eV:	-9.23(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(5-chloro-2-methyl-4-nitrophenyl)-3-methoxybutanamide

Drug info:

PubChemData

Smile

CC(CO)N(C)C(=O)CC(CN)OC

DOS

IR

Vibrations