Geometry & MOs

Info

ID:

202217

PubChem CID:

79643244

Reduced:

NOC12H17 (1)

Stoich.:

ABC12D17 (1)

Weight, g/mol:

157.146664

ΔHf, kcal/mol:

-39.79

Dipole, Da:

1.76

IP(EA), eV:

-8.75(0.42)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-[methyl(propyl)amino]cyclopentan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OC2CCC(C2)N

DOS

IR

Vibrations