Geometry & MOs

Info

ID:	350188
PubChem CID:	127277266
Reduced:	O2N4C13H20 (1)
Stoich.:	A2B4C13D20 (1)
Weight, g/mol:	364.168145
ΔH_f, kcal/mol:	-62.44
Dipole, Da:	1.78
IP(EA), eV:	-9.12(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-3-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]urea

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)N2CCOCC2)C3=NC=CN3

DOS

IR

Vibrations