Geometry & MOs

Info

ID:	197683
PubChem CID:	78987155
Reduced:	NOC8H13 (2)
Stoich.:	ABC8D13 (2)
Weight, g/mol:	253.215413
ΔH_f, kcal/mol:	-85.65
Dipole, Da:	3.58
IP(EA), eV:	-8.98(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2-(tert-butylamino)acetamide

Drug info:

PubChemData

Smile

CC(C)(C)NCC(=O)N(CCOC)CC1=CC=CC=C1

DOS

IR

Vibrations