Geometry & MOs

Info

ID:	411698
PubChem CID:	135084532
Reduced:	IO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	188.120115
ΔH_f, kcal/mol:	-69.66
Dipole, Da:	2.99
IP(EA), eV:	-9.07(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-phenylhept-6-en-2-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC(=O)CCCCI

DOS

IR

Vibrations