Geometry & MOs

Info

ID:	131623
PubChem CID:	51236215
Reduced:	SO2N4C17H18 (1)
Stoich.:	AB2C4D17E18 (1)
Weight, g/mol:	394.149718
ΔH_f, kcal/mol:	34.95
Dipole, Da:	2.25
IP(EA), eV:	-8.52(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N,N-di(propan-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)C(C)SC2=NC3=CC=CC=C3N2CC=C

DOS

IR

Vibrations