Geometry & MOs

Info

ID:	304463
PubChem CID:	124752931
Reduced:	ON5C21H29 (1)
Stoich.:	AB5C21D29 (1)
Weight, g/mol:	337.128255
ΔH_f, kcal/mol:	6.48
Dipole, Da:	5.05
IP(EA), eV:	-8.75(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)N1CC(C1)N2CCCCC2)NC3=NC=NC4=CC=CC=C43

DOS

IR

Vibrations