Geometry & MOs

Info

ID:	441318
PubChem CID:	135234106
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	344.167083
ΔH_f, kcal/mol:	-72.18
Dipole, Da:	4.14
IP(EA), eV:	-9.12(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-[3-(dimethylamino)phenyl]acetamide

Drug info:

PubChemData

Smile

CCC(=O)OC1=CC(=NCC=C1C)C(C)C

DOS

IR

Vibrations