Geometry & MOs

Info

ID:	31724
PubChem CID:	3288050
Reduced:	NC13H17 (2)
Stoich.:	AB13C17 (2)
Weight, g/mol:	485.155532
ΔH_f, kcal/mol:	11.87
Dipole, Da:	3.74
IP(EA), eV:	-7.98(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(diethylamino)-3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-pyridin-3-ylthiourea

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)C2=C(C3=CC=CC(=C3N2)C)CN4C(CCCC4C)C

DOS

IR

Vibrations