Geometry & MOs

Info

ID:	130286
PubChem CID:	51075512
Reduced:	ClNO4C15H18 (1)
Stoich.:	ABC4D15E18 (1)
Weight, g/mol:	340.082599
ΔH_f, kcal/mol:	-148.78
Dipole, Da:	3.93
IP(EA), eV:	-9.52(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[(4-chloro-2-nitrobenzoyl)amino]cyclohexane-1-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1CC2CCCCC2N1C(=O)C3=CC=C(O3)Cl

DOS

IR

Vibrations