Geometry & MOs

Info

ID:	194958
PubChem CID:	78613286
Reduced:	N3O4C23H25 (1)
Stoich.:	A3B4C23D25 (1)
Weight, g/mol:	392.058853
ΔH_f, kcal/mol:	-110.2
Dipole, Da:	2.83
IP(EA), eV:	-8.65(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[[5-[4-(trifluoromethoxy)anilino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide

Drug info:

PubChemData

Smile

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)CC4C(=O)NC5=CC=CC=C5O4

DOS

IR

Vibrations