Geometry & MOs

Info

ID:	240872
PubChem CID:	93617908
Reduced:	SO2N3C16H21 (1)
Stoich.:	AB2C3D16E21 (1)
Weight, g/mol:	319.135448
ΔH_f, kcal/mol:	-29.22
Dipole, Da:	4.27
IP(EA), eV:	-8.78(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=N1)C(=O)NC[C@@H](C2=CC=CC=C2OC)N(C)C

DOS

IR

Vibrations