Geometry & MOs

Info

ID:	243275
PubChem CID:	99218147
Reduced:	BrO2N3C20H24 (1)
Stoich.:	AB2C3D20E24 (1)
Weight, g/mol:	421.1001
ΔH_f, kcal/mol:	-42.22
Dipole, Da:	5.23
IP(EA), eV:	-8.88(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromophenyl)-N-[2-(dimethylamino)ethyl]-2-(2-methoxyethoxy)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)NC1=CC=CC(=C1)C(=O)N(CCN(C)C)C2=CC(=CC=C2)Br

DOS

IR

Vibrations