Geometry & MOs

Info

ID:	354618
PubChem CID:	127287235
Reduced:	ON4C22H32 (1)
Stoich.:	AB4C22D32 (1)
Weight, g/mol:	385.143616
ΔH_f, kcal/mol:	-13.09
Dipole, Da:	5.52
IP(EA), eV:	-8.34(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclopropyl(methyl)amino]propyl]-4-(3,5-dichloropyridin-2-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1)C3CCN(CC3)C(=O)NCC(C)N(C)C4CC4

DOS

IR

Vibrations