Geometry & MOs

Info

ID:	50072
PubChem CID:	12011984
Reduced:	ClNO4H8C13 (1)
Stoich.:	ABC4D8E13 (1)
Weight, g/mol:	200.068473
ΔH_f, kcal/mol:	-20.51
Dipole, Da:	5.17
IP(EA), eV:	-9.72(-2.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (1R,2S)-3-acetylcyclopropane-1,2-dicarboxylate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CC=C(O2)/C=C/C(=O)Cl)[N+](=O)[O-]

DOS

IR

Vibrations