Geometry & MOs

Info

ID:	198631
PubChem CID:	79127692
Reduced:	NOC16H25 (1)
Stoich.:	ABC16D25 (1)
Weight, g/mol:	199.193614
ΔH_f, kcal/mol:	-51.96
Dipole, Da:	0.96
IP(EA), eV:	-9.08(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-amino-2-methylbutan-2-yl)cycloheptan-1-ol

Drug info:

PubChemData

Smile

CCC(CN)C1(CCCCC1C2=CC=CC=C2)O

DOS

IR

Vibrations