Geometry & MOs

Info

ID:	38034
PubChem CID:	8026521
Reduced:	NOC7H11 (3)
Stoich.:	ABC7D11 (3)
Weight, g/mol:	311.149699
ΔH_f, kcal/mol:	-116.37
Dipole, Da:	3.0
IP(EA), eV:	-8.23(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1CCCC1)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC

DOS

IR

Vibrations