Geometry & MOs

Info

ID:	414536
PubChem CID:	135087495
Reduced:	FON4C17H25 (1)
Stoich.:	ABC4D17E25 (1)
Weight, g/mol:	363.171355
ΔH_f, kcal/mol:	-37.24
Dipole, Da:	2.01
IP(EA), eV:	-8.47(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chloro-5-piperidin-1-ylphenyl)-(3-morpholin-4-ylazetidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCN(C)C)CC2=CC(=C(C=C2)OC)F

DOS

IR

Vibrations