Geometry & MOs

Info

ID:	133673
PubChem CID:	51572544
Reduced:	OS2N5C21H25 (1)
Stoich.:	AB2C5D21E25 (1)
Weight, g/mol:	382.135114
ΔH_f, kcal/mol:	51.78
Dipole, Da:	5.95
IP(EA), eV:	-8.48(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-N-[(1S)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1CCC2=C(C1)SC3=C2C(=O)NC(=N3)[C@H](C)SC4=NN=C(N4C5CC5)C6CC6

DOS

IR

Vibrations