Geometry & MOs

Info

ID:	331983
PubChem CID:	127250269
Reduced:	FN4O4C23H25 (1)
Stoich.:	AB4C4D23E25 (1)
Weight, g/mol:	438.206719
ΔH_f, kcal/mol:	-171.64
Dipole, Da:	5.73
IP(EA), eV:	-9.35(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(dimethylamino)methyl]-5-methyl-1,2-oxazol-3-yl]-[2-[5-[(2-fluorophenyl)methyl]pyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

C1CNC(=O)N(C1=O)CCC(=O)N2CCOC(C2)C3=NC=C(C=C3)CC4=CC=CC=C4F

DOS

IR

Vibrations