Geometry & MOs

Info

ID:	346931
PubChem CID:	127271435
Reduced:	SO2N3C17H21 (1)
Stoich.:	AB2C3D17E21 (1)
Weight, g/mol:	331.135448
ΔH_f, kcal/mol:	-48.95
Dipole, Da:	5.16
IP(EA), eV:	-8.8(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(4-methyl-1,3-thiazol-2-yl)phenyl]-3-(oxan-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2=CC(=CC=C2)NC(=O)NCC3CCCCO3

DOS

IR

Vibrations