Geometry & MOs

Info

ID:	343546
PubChem CID:	127266719
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	328.153541
ΔH_f, kcal/mol:	-34.72
Dipole, Da:	3.69
IP(EA), eV:	-8.76(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-morpholin-4-ylphenyl)ethyl]-3-nitropyridin-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)COC)NCCC2=CC=CC=C2N3CCOCC3

DOS

IR

Vibrations