Geometry & MOs

Info

ID:	4082
PubChem CID:	10719
Reduced:	C7H8 (2)
Stoich.:	A7B8 (2)
Weight, g/mol:	184.125201
ΔH_f, kcal/mol:	45.3
Dipole, Da:	1.51
IP(EA), eV:	-7.8(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-ethyl-1,4-dimethylazulene

Drug info:

PubChemData

Smile

CCC1=CC2=C(C=CC2=C(C=C1)C)C

DOS

IR

Vibrations