Geometry & MOs

Info

ID:	122292
PubChem CID:	50801275
Reduced:	SN3O4C18H23 (1)
Stoich.:	AB3C4D18E23 (1)
Weight, g/mol:	415.189592
ΔH_f, kcal/mol:	-108.6
Dipole, Da:	7.82
IP(EA), eV:	-10.12(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dimethoxyphenyl)-3-[2-(1H-indol-3-yl)-2-phenylethyl]urea

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)CC2=NOC(=N2)CCC(=O)NC3CCCC3

DOS

IR

Vibrations