Geometry & MOs

Info

ID:	344072
PubChem CID:	127267248
Reduced:	O3N4C17H22 (1)
Stoich.:	A3B4C17D22 (1)
Weight, g/mol:	334.146347
ΔH_f, kcal/mol:	-86.92
Dipole, Da:	3.76
IP(EA), eV:	-9.59(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(3-hydroxy-2,2-dimethyl-1-phenylpropyl)urea

Drug info:

PubChemData

Smile

CC(C)(CO)C(C1=CC=CC=C1)NC(=O)NC2=CC(=NC=N2)OC

DOS

IR

Vibrations