Geometry & MOs

Info

ID:	202661
PubChem CID:	79707082
Reduced:	N2C17H34 (1)
Stoich.:	A2B17C34 (1)
Weight, g/mol:	326.09938
ΔH_f, kcal/mol:	-44.89
Dipole, Da:	2.63
IP(EA), eV:	-8.4(2.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-4-methoxyphenyl)-N-(piperidin-4-ylmethyl)ethanamine

Drug info:

PubChemData

Smile

CC(C)(C)C1CCC(CC1)N(C)CC2CCNCC2

DOS

IR

Vibrations