Geometry & MOs

Info

ID:	385010
PubChem CID:	134978142
Reduced:	PC22H41 (1)
Stoich.:	AB22C41 (1)
Weight, g/mol:	270.044757
ΔH_f, kcal/mol:	-83.8
Dipole, Da:	1.33
IP(EA), eV:	-7.96(2.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenyl)-3-[hydroxy(phenyl)methyl]cycloprop-2-en-1-one

Drug info:

PubChemData

Smile

CC(C)(C1CCCC1)P(C2CCCCC2)C(C)(C)C3CCCC3

DOS

IR

Vibrations