Geometry & MOs

Info

ID:	206809
PubChem CID:	80304086
Reduced:	O2N3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	306.140199
ΔH_f, kcal/mol:	-43.35
Dipole, Da:	2.04
IP(EA), eV:	-9.2(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethyl-4-hydroxybutyl)-2-phenyl-4,5-dihydro-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCC(CCO)CNC(=O)C1=CC(=NN1)C2=CC=CC=C2

DOS

IR

Vibrations