Geometry & MOs

Info

ID:	277021
PubChem CID:	103826298
Reduced:	NO2C17H35 (1)
Stoich.:	AB2C17D35 (1)
Weight, g/mol:	271.251129
ΔH_f, kcal/mol:	-148.8
Dipole, Da:	2.08
IP(EA), eV:	-8.97(2.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-tert-butylcycloheptyl)amino]-4-methoxybutan-1-ol

Drug info:

PubChemData

Smile

CC(C)(C)C1CCCC(CC1)NCC(C)(CCOC)O

DOS

IR

Vibrations