Geometry & MOs

Info

ID:	205401
PubChem CID:	80095709
Reduced:	ON2C18H28 (1)
Stoich.:	AB2C18D28 (1)
Weight, g/mol:	288.220164
ΔH_f, kcal/mol:	-27.16
Dipole, Da:	2.0
IP(EA), eV:	-8.37(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-cyclopropyl-5-methyl-2-propan-2-ylpiperazin-1-yl)methyl]phenol

Drug info:

PubChemData

Smile

CCCC1CNC(CN1CC2=CC(=CC=C2)O)(C)C3CC3

DOS

IR

Vibrations