Geometry & MOs

Info

ID:	348521
PubChem CID:	127273632
Reduced:	SO4N5C14H25 (1)
Stoich.:	AB4C5D14E25 (1)
Weight, g/mol:	322.121195
ΔH_f, kcal/mol:	-141.26
Dipole, Da:	10.58
IP(EA), eV:	-8.28(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(2-morpholin-4-ylethyl)-2-(1H-1,2,4-triazol-5-yl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)NCC(=O)N(C)CCN2CCOCC2

DOS

IR

Vibrations