Geometry & MOs

Info

ID:	386881
PubChem CID:	134983237
Reduced:	C3H4 (8)
Stoich.:	A3B4 (8)
Weight, g/mol:	328.167459
ΔH_f, kcal/mol:	94.45
Dipole, Da:	0.91
IP(EA), eV:	-8.68(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl (5Z)-5-benzylidene-3-methylcyclohex-3-ene-1,1-dicarboxylate

Drug info:

PubChemData

Smile

CC(=C=C1C(=C=C(C)C)C2(C13C4C3CCCC4)C5C2CCCC5)C

DOS

IR

Vibrations