Geometry & MOs

Info

ID:	47772
PubChem CID:	10535194
Reduced:	OC2H3 (4)
Stoich.:	AB2C3 (4)
Weight, g/mol:	172.052429
ΔH_f, kcal/mol:	-171.89
Dipole, Da:	2.37
IP(EA), eV:	-9.13(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxyazulene-1-carbaldehyde

Drug info:

PubChemData

Smile

CC1=C(OCC1O)CC(=O)OC

DOS

IR

Vibrations