Geometry & MOs

Info

ID:	56459
PubChem CID:	17432520
Reduced:	NO2H10C11 (2)
Stoich.:	AB2C10D11 (2)
Weight, g/mol:	331.135448
ΔH_f, kcal/mol:	-96.99
Dipole, Da:	2.01
IP(EA), eV:	-8.32(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(oxolan-2-ylmethyl)-5-phenylimidazol-2-yl]sulfanylpropanamide

Drug info:

PubChemData

Smile

C1COC2=C(C=C(C=C2)NC(=O)CNC(=O)C3=CC4=CC=CC=C4C=C3)OC1

DOS

IR

Vibrations