Geometry & MOs

Info

ID:	352181
PubChem CID:	127283249
Reduced:	SN2O5C14H18 (1)
Stoich.:	AB2C5D14E18 (1)
Weight, g/mol:	294.151433
ΔH_f, kcal/mol:	-178.26
Dipole, Da:	5.82
IP(EA), eV:	-8.94(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpiperidin-4-yl)-3-[(4-methyl-1,3-thiazol-5-yl)methyl]urea

Drug info:

PubChemData

Smile

CC(C1=CC2=C(C=C1)OCO2)NC(=O)N3CCS(=O)(=O)CC3

DOS

IR

Vibrations