Geometry & MOs

Info

ID:	37320
PubChem CID:	8019527
Reduced:	NO3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	281.081871
ΔH_f, kcal/mol:	-121.94
Dipole, Da:	2.84
IP(EA), eV:	-8.52(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(3-chloroanilino)-1-oxopropan-2-yl] (1S,2S)-2-methylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2CCC2)C

DOS

IR

Vibrations