Geometry & MOs

Info

ID:	343269
PubChem CID:	127266442
Reduced:	FN2O4C17H25 (1)
Stoich.:	AB2C4D17E25 (1)
Weight, g/mol:	336.195011
ΔH_f, kcal/mol:	-240.61
Dipole, Da:	2.41
IP(EA), eV:	-8.77(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(1-pyrimidin-2-ylpiperidin-4-yl)methanone

Drug info:

PubChemData

Smile

CCOCCCC(=O)NC1=C(C=CC(=C1)NC(=O)OC(C)(C)C)F

DOS

IR

Vibrations