Geometry & MOs

Info

ID:	305480
PubChem CID:	124956038
Reduced:	SO4N5C24H29 (1)
Stoich.:	AB4C5D24E29 (1)
Weight, g/mol:	356.184841
ΔH_f, kcal/mol:	-93.76
Dipole, Da:	1.95
IP(EA), eV:	-9.28(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-1-[(2S)-2-[6-[(6-methylpyridin-2-yl)amino]pyridin-2-yl]morpholin-4-yl]propan-1-one

Drug info:

PubChemData

Smile

CN(C[C@]1(CCCN(C1)C2=C3C=NC=CC3=NC=C2)O)C(=O)CCC4=CC=C(C=C4)S(=O)(=O)N

DOS

IR

Vibrations