Geometry & MOs

Info

ID:	370206
PubChem CID:	127337739
Reduced:	S2N3O5C15H29 (1)
Stoich.:	A2B3C5D15E29 (1)
Weight, g/mol:	374.188881
ΔH_f, kcal/mol:	-215.75
Dipole, Da:	3.13
IP(EA), eV:	-8.61(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-ethyl-1,3-thiazol-4-yl)ethyl]-3-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]urea

Drug info:

PubChemData

Smile

CC1C(S(=O)CCN1C(=O)NCCS(=O)(=O)NCC2CCCCO2)C

DOS

IR

Vibrations