Geometry & MOs

Info

ID:	324432
PubChem CID:	126677665
Reduced:	NSO3C13H23 (1)
Stoich.:	ABC3D13E23 (1)
Weight, g/mol:	137.120449
ΔH_f, kcal/mol:	-151.5
Dipole, Da:	2.93
IP(EA), eV:	-9.04(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-cyclopropyl-2,3-dimethylbutanenitrile

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)OC)NC(=O)CC/C=C/CCS

DOS

IR

Vibrations