Geometry & MOs

Info

ID:	345473
PubChem CID:	127269773
Reduced:	ON2C8H13 (2)
Stoich.:	AB2C8D13 (2)
Weight, g/mol:	337.109627
ΔH_f, kcal/mol:	-70.75
Dipole, Da:	4.82
IP(EA), eV:	-9.9(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)-3-(2-oxopiperidin-3-yl)urea

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C(C)NC(=O)NC2CCC3CCCCC3C2

DOS

IR

Vibrations