Geometry & MOs

Info

ID:	423920
PubChem CID:	135120755
Reduced:	OSN5C19H23 (1)
Stoich.:	ABC5D19E23 (1)
Weight, g/mol:	346.236876
ΔH_f, kcal/mol:	6.22
Dipole, Da:	1.54
IP(EA), eV:	-8.43(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propylamino]pyridin-4-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CSC1=CC=CC(=C1)NC(=O)N2CCCC3(C2)CCC4=CN=C(N=C34)N

DOS

IR

Vibrations