Geometry & MOs

Info

ID:	407838
PubChem CID:	135080593
Reduced:	NOC12H25 (1)
Stoich.:	ABC12D25 (1)
Weight, g/mol:	195.043262
ΔH_f, kcal/mol:	-93.18
Dipole, Da:	2.81
IP(EA), eV:	-8.49(2.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-cyanophenyl)oxirane-2,2-dicarbonitrile

Drug info:

PubChemData

Smile

CC(C)(CCCC1CCCCN1C)O

DOS

IR

Vibrations