Geometry & MOs

Info

ID:	368242
PubChem CID:	127327794
Reduced:	O2S2N5C15H21 (1)
Stoich.:	A2B2C5D15E21 (1)
Weight, g/mol:	381.129317
ΔH_f, kcal/mol:	-18.72
Dipole, Da:	4.48
IP(EA), eV:	-8.62(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]-3-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]urea

Drug info:

PubChemData

Smile

CC(C)(C1=NC=CS1)NC(=O)NC2=NC(=CS2)CN3CCOCC3

DOS

IR

Vibrations