Geometry & MOs

Info

ID:	77450
PubChem CID:	49635607
Reduced:	SN3O4C19H25 (1)
Stoich.:	AB3C4D19E25 (1)
Weight, g/mol:	409.112999
ΔH_f, kcal/mol:	-129.79
Dipole, Da:	1.25
IP(EA), eV:	-9.1(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(cyclopropylsulfamoyl)phenyl]methyl]-1-(2-hydroxyethyl)-1-(thiophen-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CC1=C(C=CO1)C(=O)N2CCC(CC2)NC(=O)N(CCO)CC3=CSC=C3

DOS

IR

Vibrations