Geometry & MOs

Info

ID:	73689
PubChem CID:	48420020
Reduced:	NS2O5C12H19 (1)
Stoich.:	AB2C5D12E19 (1)
Weight, g/mol:	325.117489
ΔH_f, kcal/mol:	-172.62
Dipole, Da:	10.56
IP(EA), eV:	-9.24(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-dioxoisoindol-5-yl)-3-[2-(pyridin-2-ylamino)ethyl]urea

Drug info:

PubChemData

Smile

CC(=CCS(=O)(=O)CC1=CC=C(O1)S(=O)(=O)N(C)C)C

DOS

IR

Vibrations