Geometry & MOs

Info

ID:	55959
PubChem CID:	17397849
Reduced:	ClN2O3C11H13 (1)
Stoich.:	AB2C3D11E13 (1)
Weight, g/mol:	372.074839
ΔH_f, kcal/mol:	-42.06
Dipole, Da:	7.18
IP(EA), eV:	-9.23(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)O

DOS

IR

Vibrations