Geometry & MOs

Info

ID:	191134
PubChem CID:	78108757
Reduced:	N2O8C29H36 (1)
Stoich.:	A2B8C29D36 (1)
Weight, g/mol:	330.115047
ΔH_f, kcal/mol:	-342.32
Dipole, Da:	5.58
IP(EA), eV:	-8.65(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[(3,4-dimethoxyphenyl)-(6-methylpyridin-2-yl)methylidene]amino]thiourea

Drug info:

PubChemData

Smile

CC(C(=O)O)OC(=O)C(CCCCNC(=O)OC(C)(C)C)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

DOS

IR

Vibrations