Geometry & MOs

Info

ID:	235310
PubChem CID:	92309392
Reduced:	SO2N5C17H23 (1)
Stoich.:	AB2C5D17E23 (1)
Weight, g/mol:	361.157246
ΔH_f, kcal/mol:	-26.0
Dipole, Da:	4.34
IP(EA), eV:	-8.26(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethoxyphenyl)-3-[5-[(3R)-3-methylpiperidin-1-yl]-1,3,4-thiadiazol-2-yl]urea

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)N3CCC[C@@H](C3)C

DOS

IR

Vibrations