Geometry & MOs

Info

ID:	277833
PubChem CID:	103831142
Reduced:	ON2F3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	290.199428
ΔH_f, kcal/mol:	-211.76
Dipole, Da:	6.02
IP(EA), eV:	-8.92(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC1=CC(=C(C=C1)C)C(F)(F)F)N

DOS

IR

Vibrations