Geometry & MOs

Info

ID:	148258
PubChem CID:	53787920
Reduced:	PSN2O4C19H23 (1)
Stoich.:	ABC2D4E19F23 (1)
Weight, g/mol:	348.075596
ΔH_f, kcal/mol:	-172.6
Dipole, Da:	6.2
IP(EA), eV:	-8.89(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-dichloro-4-hydroxy-3-methoxyphenyl)-1-methyl-3-(N'-propylcarbamimidoyl)urea

Drug info:

PubChemData

Smile

CCCSP(=O)(OCC)OC1=CC=C(C=C1)C=NNC(=O)C2=CC=CC=C2

DOS

IR

Vibrations