Geometry & MOs

Info

ID:	27972
PubChem CID:	824488
Reduced:	SN2O2C16H16 (1)
Stoich.:	AB2C2D16E16 (1)
Weight, g/mol:	301.124883
ΔH_f, kcal/mol:	-15.32
Dipole, Da:	5.65
IP(EA), eV:	-8.51(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(dimethylamino)-4-phenyl-1,3-thiazol-5-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)C(=S)NC(=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations