Geometry & MOs

Info

ID:	329426
PubChem CID:	126736633
Reduced:	NOC8H11 (3)
Stoich.:	ABC8D11 (3)
Weight, g/mol:	438.263091
ΔH_f, kcal/mol:	-105.53
Dipole, Da:	1.64
IP(EA), eV:	-8.91(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(1S,5R)-8-[2-[[1-(methoxymethyl)cyclopropyl]amino]-2-oxoethyl]-8-azabicyclo[3.2.1]octan-3-yl]methyl]-1-methylindole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)N(C)C(=O)CN1C2CCC1CC(C2)CNC(=O)C3=COC4=CC=CC=C43

DOS

IR

Vibrations