Geometry & MOs

Info

ID:	422237
PubChem CID:	135117470
Reduced:	FNO4C14H16 (1)
Stoich.:	ABC4D14E16 (1)
Weight, g/mol:	320.188863
ΔH_f, kcal/mol:	-212.32
Dipole, Da:	6.36
IP(EA), eV:	-9.75(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methylpyridin-4-yl)methyl]-2-phenylspiro[2.4]heptane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)F)C(=O)N2CC[C@@H]([C@@H](C2)O)C(=O)O

DOS

IR

Vibrations