Geometry & MOs

Info

ID:	288415
PubChem CID:	104316455
Reduced:	NO3C10H21 (1)
Stoich.:	AB3C10D21 (1)
Weight, g/mol:	215.188529
ΔH_f, kcal/mol:	-161.11
Dipole, Da:	3.77
IP(EA), eV:	-9.05(1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(aminomethyl)cycloheptyl]oxybutan-2-ol

Drug info:

PubChemData

Smile

CC(CCOC1(CCOCC1)CN)O

DOS

IR

Vibrations