Geometry & MOs

Info

ID:	433227
PubChem CID:	135173364
Reduced:	N3O4C21H25 (1)
Stoich.:	A3B4C21D25 (1)
Weight, g/mol:	407.166748
ΔH_f, kcal/mol:	-107.4
Dipole, Da:	4.74
IP(EA), eV:	-9.14(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-methoxy-3-[3-(methylamino)anilino]sulfanylphenyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

C1CN(CCC1COC2=COC(=CC2=O)CN3CC4=CC=CC=C4C3)C(=O)N

DOS

IR

Vibrations