Geometry & MOs

Info

ID:	58137
PubChem CID:	24424275
Reduced:	SO2N3H19C20 (1)
Stoich.:	AB2C3D19E20 (1)
Weight, g/mol:	345.114713
ΔH_f, kcal/mol:	-2.37
Dipole, Da:	9.46
IP(EA), eV:	-8.44(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-hydroxynaphthalene-2-carbonyl)amino]-3-(oxolan-2-ylmethyl)thiourea

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=S)NNC(=O)C2=CC3=CC=CC=C3C=C2O

DOS

IR

Vibrations