Geometry & MOs

Info

ID:	2839
PubChem CID:	8695
Reduced:	ClN2O2C15H25 (1)
Stoich.:	AB2C2D15E25 (1)
Weight, g/mol:	300.160456
ΔH_f, kcal/mol:	-119.92
Dipole, Da:	4.25
IP(EA), eV:	-8.74(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethylamino)ethyl 4-(butylamino)benzoate;hydrochloride

Drug info:

PubChemData

Smile

CCCCNC1=CC=C(C=C1)C(=O)OCCN(C)C.Cl

DOS

IR

Vibrations