Geometry & MOs

Info

ID:	386494
PubChem CID:	134981926
Reduced:	O2C9H14 (1)
Stoich.:	A2B9C14 (1)
Weight, g/mol:	369.155121
ΔH_f, kcal/mol:	-78.13
Dipole, Da:	1.63
IP(EA), eV:	-9.53(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5-dibenzyl-3-methylsulfanyl-2-phenylpyrrole

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H](C)/C=C/C=C

DOS

IR

Vibrations