Geometry & MOs

Info

ID:	171439
PubChem CID:	75377161
Reduced:	OSN4C18H22 (1)
Stoich.:	ABC4D18E22 (1)
Weight, g/mol:	348.161997
ΔH_f, kcal/mol:	9.07
Dipole, Da:	4.65
IP(EA), eV:	-8.95(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]-3-[(2-propan-2-yloxypyridin-3-yl)methyl]urea

Drug info:

PubChemData

Smile

C1CCC2(CC1)CN(CCS2)C(=O)C3=CN=C(C=C3)N4C=CN=C4

DOS

IR

Vibrations