Geometry & MOs

Info

ID:	255949
PubChem CID:	103135843
Reduced:	FN3H16C17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	253.240565
ΔH_f, kcal/mol:	33.75
Dipole, Da:	3.77
IP(EA), eV:	-9.2(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-amine

Drug info:

PubChemData

Smile

CCNC(C1=NC=C(C=C1)F)C2=CC=CC3=C2C=NC=C3

DOS

IR

Vibrations