Geometry & MOs

Info

ID:	26706
PubChem CID:	794682
Reduced:	NO2H15C18 (1)
Stoich.:	AB2C15D18 (1)
Weight, g/mol:	308.109568
ΔH_f, kcal/mol:	6.65
Dipole, Da:	3.14
IP(EA), eV:	-8.28(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1H-indol-3-ylmethylideneamino)-3-(3-methylphenyl)thiourea

Drug info:

PubChemData

Smile

COC1=C(C2=CC=CC=C2C=C1)C=NC3=CC=C(C=C3)O

DOS

IR

Vibrations