Geometry & MOs

Info

ID:	27853
PubChem CID:	823925
Reduced:	N2O2H16C21 (1)
Stoich.:	A2B2C16D21 (1)
Weight, g/mol:	346.098728
ΔH_f, kcal/mol:	16.05
Dipole, Da:	4.74
IP(EA), eV:	-8.72(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-(4-methoxyphenoxy)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4

DOS

IR

Vibrations