Geometry & MOs

Info

ID:	274978
PubChem CID:	103812957
Reduced:	FN2O2C14H19 (1)
Stoich.:	AB2C2D14E19 (1)
Weight, g/mol:	254.199428
ΔH_f, kcal/mol:	-126.71
Dipole, Da:	3.49
IP(EA), eV:	-8.88(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[(4-methyloxan-4-yl)methyl]cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCOCC1)CNC(=O)C2=CC(=C(C=C2)F)N

DOS

IR

Vibrations