Geometry & MOs

Info

ID:	184519
PubChem CID:	77171971
Reduced:	BrNSiO2C21H32 (1)
Stoich.:	ABCD2E21F32 (1)
Weight, g/mol:	359.257277
ΔH_f, kcal/mol:	-121.5
Dipole, Da:	2.6
IP(EA), eV:	-7.52(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[2-(oxan-4-yl)-1-piperidin-4-ylethyl]-3-phenylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)N2C(CC(C2=O)(C)C)C(C)(C)O[Si]C(C)(C)C

DOS

IR

Vibrations