Geometry & MOs

Info

ID:	258900
PubChem CID:	103157381
Reduced:	NO2C17H25 (1)
Stoich.:	AB2C17D25 (1)
Weight, g/mol:	277.204179
ΔH_f, kcal/mol:	-86.45
Dipole, Da:	1.6
IP(EA), eV:	-8.72(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-[[3-(methoxymethyl)phenyl]methylamino]propan-2-ol

Drug info:

PubChemData

Smile

C1CCC(C1)CC(CNCC2CC3=CC=CC=C3O2)O

DOS

IR

Vibrations