Geometry & MOs

Info

ID:	158420
PubChem CID:	56463613
Reduced:	ClN2O3C22H25 (1)
Stoich.:	AB2C3D22E25 (1)
Weight, g/mol:	366.13068
ΔH_f, kcal/mol:	-63.84
Dipole, Da:	4.05
IP(EA), eV:	-8.99(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-bromophenyl)-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide

Drug info:

PubChemData

Smile

CC(CNC(=O)COC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl)N(C)C3CC3

DOS

IR

Vibrations