Geometry & MOs

Info

ID:	45407
PubChem CID:	10512838
Reduced:	OC14H30 (1)
Stoich.:	AB14C30 (1)
Weight, g/mol:	215.131014
ΔH_f, kcal/mol:	-118.31
Dipole, Da:	2.12
IP(EA), eV:	-10.17(2.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[hydroxy(phenyl)methyl]hept-6-enenitrile

Drug info:

PubChemData

Smile

CCCCCCC(CCC(C)CCC)O

DOS

IR

Vibrations