Geometry & MOs

Info

ID:	419922
PubChem CID:	135109815
Reduced:	ON4C16H18 (1)
Stoich.:	AB4C16D18 (1)
Weight, g/mol:	368.184841
ΔH_f, kcal/mol:	18.66
Dipole, Da:	4.35
IP(EA), eV:	-8.98(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

morpholin-4-yl-[6-[[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]amino]pyridin-3-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(N=C1C)N2CC(C2)C3=CC=NC=C3)C(=O)N

DOS

IR

Vibrations