Geometry & MOs

Info

ID:	368936
PubChem CID:	127330955
Reduced:	SN3O3C17H25 (1)
Stoich.:	AB3C3D17E25 (1)
Weight, g/mol:	386.177647
ΔH_f, kcal/mol:	-124.35
Dipole, Da:	6.36
IP(EA), eV:	-8.54(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-benzylpiperidin-2-yl)methyl]-3-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)urea

Drug info:

PubChemData

Smile

C1CCC(C1)OC2CCN(CC2)C(=O)NC3=NC4=C(S3)COCC4

DOS

IR

Vibrations