Geometry & MOs

Info

ID:	195318
PubChem CID:	78672375
Reduced:	OS2N4C16H22 (1)
Stoich.:	AB2C4D16E22 (1)
Weight, g/mol:	414.118418
ΔH_f, kcal/mol:	7.87
Dipole, Da:	6.27
IP(EA), eV:	-8.57(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-phenylmethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CCNC1=NN=C(S1)SC(C)C(=O)NC2=CC=C(C=C2)C(C)C

DOS

IR

Vibrations