Geometry & MOs

Info

ID:	164278
PubChem CID:	74382697
Reduced:	N2O3C20H32 (1)
Stoich.:	A2B3C20D32 (1)
Weight, g/mol:	322.225643
ΔH_f, kcal/mol:	-141.64
Dipole, Da:	4.21
IP(EA), eV:	-8.41(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(dimethylamino)-3-methylpentyl] 4-amino-2-propoxybenzoate

Drug info:

PubChemData

Smile

CCCOC1=C(C=CC(=C1)C(=O)OCC(C(C)C)N2CCCCC2)N

DOS

IR

Vibrations