Geometry & MOs

Info

ID:	331810
PubChem CID:	127250094
Reduced:	O2N4C23H24 (1)
Stoich.:	A2B4C23D24 (1)
Weight, g/mol:	392.164854
ΔH_f, kcal/mol:	-6.54
Dipole, Da:	5.0
IP(EA), eV:	-9.14(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-aminopyridin-3-yl)-[2-[6-[(4-fluorophenyl)methyl]pyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC2=NC(=CC=C2)C3CN(CCO3)C(=O)C4=CN=C(C=C4)N

DOS

IR

Vibrations