Geometry & MOs

Info

ID:	331643
PubChem CID:	127249726
Reduced:	N2O2C12H13 (2)
Stoich.:	A2B2C12D13 (2)
Weight, g/mol:	440.151826
ΔH_f, kcal/mol:	-81.84
Dipole, Da:	2.57
IP(EA), eV:	-8.65(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-[4-(4-methoxyphenyl)sulfonylmorpholin-2-yl]pyridin-2-yl]-6-methylpyridin-2-amine

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC2=CC=CC(=N2)C3CN(CCO3)C(=O)C4=C(C=CC=C4OC)OC

DOS

IR

Vibrations