Geometry & MOs

Info

ID:	127770
PubChem CID:	51014449
Reduced:	BClOSiC31H46 (1)
Stoich.:	ABCDE31F46 (1)
Weight, g/mol:	370.189257
ΔH_f, kcal/mol:	-133.76
Dipole, Da:	2.02
IP(EA), eV:	-8.92(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,5R)-8-(furan-2-ylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]-3,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

B(CCC(CC)O[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C(C)(C)C)(C3C[C@H]4C[C@H](C3C)C4(C)C)Cl

DOS

IR

Vibrations