Geometry & MOs

Info

ID:	64526
PubChem CID:	29202767
Reduced:	FO2N3C21H22 (1)
Stoich.:	AB2C3D21E22 (1)
Weight, g/mol:	281.137556
ΔH_f, kcal/mol:	-51.49
Dipole, Da:	1.85
IP(EA), eV:	-8.82(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethylamino)-N-(3-methoxypropyl)-5-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NCCCOC)C3=CC=C(C=C3)F

DOS

IR

Vibrations