Geometry & MOs

Info

ID:	24083
PubChem CID:	607778
Reduced:	OC14H14 (1)
Stoich.:	AB14C14 (1)
Weight, g/mol:	198.104465
ΔH_f, kcal/mol:	59.63
Dipole, Da:	6.63
IP(EA), eV:	-8.94(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6,8-trimethylazulene-1-carbaldehyde

Drug info:

PubChemData

Smile

CC1=CC(=C2C=CC(=C2C(=C1)C)C=O)C

DOS

IR

Vibrations