Geometry & MOs

Info

ID:	337459
PubChem CID:	127257144
Reduced:	N2O3H14C15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	250.229666
ΔH_f, kcal/mol:	-39.17
Dipole, Da:	3.43
IP(EA), eV:	-9.12(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z,8Z,11E)-heptadeca-4,8,11-trien-1-ol

Drug info:

PubChemData

Smile

CCC1C(=O)C2=C(C1=O)OC(C=N2)NC3=CC=CC=C3

DOS

IR

Vibrations