Geometry & MOs

Info

ID:	149208
PubChem CID:	53788880
Reduced:	NO4C10H11 (1)
Stoich.:	AB4C10D11 (1)
Weight, g/mol:	336.082016
ΔH_f, kcal/mol:	-120.04
Dipole, Da:	6.33
IP(EA), eV:	-9.56(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzhydryl 3-oxo-2-thiophen-2-ylpropanoate

Drug info:

PubChemData

Smile

CC(C(=O)C1=CC=CC=C1NO)C(=O)O

DOS

IR

Vibrations