Geometry & MOs

Info

ID:	418962
PubChem CID:	135107225
Reduced:	NF3O3C14H22 (1)
Stoich.:	AB3C3D14E22 (1)
Weight, g/mol:	372.158626
ΔH_f, kcal/mol:	-336.97
Dipole, Da:	5.61
IP(EA), eV:	-9.69(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-methyl-2-pyridin-3-ylquinoline-4-carboxamide

Drug info:

PubChemData

Smile

CC1(CCOC2(C1)CCN(CC2)C(=O)CCC(F)(F)F)O

DOS

IR

Vibrations