Geometry & MOs

Info

ID:	220922
PubChem CID:	85240509
Reduced:	O3H18C19 (1)
Stoich.:	A3B18C19 (1)
Weight, g/mol:	294.16198
ΔH_f, kcal/mol:	-44.39
Dipole, Da:	5.57
IP(EA), eV:	-9.39(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hex-1-enyl 2,2-diphenylacetate

Drug info:

PubChemData

Smile

C=C1CC23CC4=C(CC2(CC1=C)C(=O)OC3=O)C5CC4C=C5

DOS

IR

Vibrations