Geometry & MOs

Info

ID:	51043
PubChem CID:	12013660
Reduced:	ON2H16C18 (1)
Stoich.:	AB2C16D18 (1)
Weight, g/mol:	310.084993
ΔH_f, kcal/mol:	21.49
Dipole, Da:	7.42
IP(EA), eV:	-9.07(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-bis(phenylsulfanyl)bicyclo[2.2.1]hept-2-ene

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2CN3C1=NC(=O)C4=CC=CC=C43)C

DOS

IR

Vibrations