Geometry & MOs

Info

ID:	29276
PubChem CID:	832766
Reduced:	NO5H11C15 (1)
Stoich.:	AB5C11D15 (1)
Weight, g/mol:	296.188863
ΔH_f, kcal/mol:	-70.37
Dipole, Da:	4.1
IP(EA), eV:	-10.09(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ylidene]amino]-3-phenylpropanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H]2C(=O)O[C@@H](O2)C3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations