Geometry & MOs

Info

ID:	26742
PubChem CID:	796904
Reduced:	O3H8C9 (1)
Stoich.:	A3B8C9 (1)
Weight, g/mol:	322.113984
ΔH_f, kcal/mol:	-78.09
Dipole, Da:	5.39
IP(EA), eV:	-9.42(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methoxyphenyl)methyl]-3-naphthalen-1-ylthiourea

Drug info:

PubChemData

Smile

C\1COC(=O)/C1=C/C2=CC=CO2

DOS

IR

Vibrations