Geometry & MOs

Info

ID:	30796
PubChem CID:	841924
Reduced:	NO2C23H23 (1)
Stoich.:	AB2C23D23 (1)
Weight, g/mol:	279.140533
ΔH_f, kcal/mol:	-22.61
Dipole, Da:	3.87
IP(EA), eV:	-8.72(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylphenyl)-3-(2-morpholin-4-ylethyl)thiourea

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)OCC2=CC(=CC=C2)C(=O)NCC3=CC=CC=C3

DOS

IR

Vibrations