Geometry & MOs

Info

ID:	146172
PubChem CID:	53647511
Reduced:	SN2C5H10 (1)
Stoich.:	AB2C5D10 (1)
Weight, g/mol:	588.164031
ΔH_f, kcal/mol:	10.23
Dipole, Da:	7.0
IP(EA), eV:	-8.49(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-methylsulfonyloxy-3-prop-1-enylphenyl)-diphenylmethyl]-2-prop-1-enylphenyl] methanesulfonate

Drug info:

PubChemData

Smile

CC=CCNC(=S)N

DOS

IR

Vibrations