Geometry & MOs

Info

ID:	448889
PubChem CID:	135294321
Reduced:	OSN4C19H24 (1)
Stoich.:	ABC4D19E24 (1)
Weight, g/mol:	350.202799
ΔH_f, kcal/mol:	22.85
Dipole, Da:	2.96
IP(EA), eV:	-8.97(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(5-methoxythiophen-2-yl)-3-(3-methyl-8-azabicyclo[3.2.1]octan-8-yl)propyl]propanamide

Drug info:

PubChemData

Smile

CC1CC2CCC(C1)N2CC[C@@H](C3=CC=C(S3)C#N)NC(=O)CC#N

DOS

IR

Vibrations