Geometry & MOs

Info

ID:	281806
PubChem CID:	103914394
Reduced:	ON2C12H26 (1)
Stoich.:	AB2C12D26 (1)
Weight, g/mol:	226.204513
ΔH_f, kcal/mol:	-81.46
Dipole, Da:	2.84
IP(EA), eV:	-8.62(2.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-[[1-(cyclopropylmethyl)piperidin-4-yl]amino]butan-1-ol

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)N[C@H](C)CCO

DOS

IR

Vibrations