Geometry & MOs

Info

ID:	359279
PubChem CID:	127297876
Reduced:	O2N6C13H16 (1)
Stoich.:	A2B6C13D16 (1)
Weight, g/mol:	363.107519
ΔH_f, kcal/mol:	6.5
Dipole, Da:	3.63
IP(EA), eV:	-9.02(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCOC1)C(=O)NC2=C(N=CC=C2)N3C=NC=N3

DOS

IR

Vibrations