Geometry & MOs

Info

ID:	387732
PubChem CID:	134986631
Reduced:	N4C15H18 (1)
Stoich.:	A4B15C18 (1)
Weight, g/mol:	222.100442
ΔH_f, kcal/mol:	103.28
Dipole, Da:	6.1
IP(EA), eV:	-10.48(-2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z,4R)-2-(2-nitrocyclopenta-2,4-dien-1-ylidene)-4-propan-2-yl-1,3-oxazolidine

Drug info:

PubChemData

Smile

CCC1=C(C(=NC#N)C(=CC1=NC#N)C(C)(C)C)C

DOS

IR

Vibrations