Geometry & MOs

Info

ID:	412739
PubChem CID:	135085653
Reduced:	NOPC24H26 (1)
Stoich.:	ABCD24E26 (1)
Weight, g/mol:	175.079727
ΔH_f, kcal/mol:	-26.44
Dipole, Da:	1.9
IP(EA), eV:	-9.29(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)pent-4-enenitrile

Drug info:

PubChemData

Smile

CCC/C(=N\P(=O)(C1=CC=CC=C1C)C2=CC=CC=C2C)/C3=CC=CC=C3

DOS

IR

Vibrations