Geometry & MOs

Info

ID:	298020
PubChem CID:	117646995
Reduced:	NO3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	189.08235
ΔH_f, kcal/mol:	-129.01
Dipole, Da:	1.4
IP(EA), eV:	-9.39(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-nitro-1-propylsulfanylethyl)cyclopropane

Drug info:

PubChemData

Smile

C[C@@H](CN(CC1=CC=CC=C1)C(=O)[C@H](C)O)O

DOS

IR

Vibrations