Geometry & MOs

Info

ID:	405883
PubChem CID:	135075836
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	308.27153
ΔH_f, kcal/mol:	-98.06
Dipole, Da:	6.42
IP(EA), eV:	-9.6(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

icos-10-enedial

Drug info:

PubChemData

Smile

C1CC2C(C(C1O2)C(=O)O)NCC3=CC=CC=C3

DOS

IR

Vibrations