Geometry & MOs

Info

ID:	431063
PubChem CID:	135171133
Reduced:	NO4C17H23 (1)
Stoich.:	AB4C17D23 (1)
Weight, g/mol:	377.210327
ΔH_f, kcal/mol:	-167.46
Dipole, Da:	5.02
IP(EA), eV:	-9.54(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5R)-5-(benzylamino)oxan-3-yl]-N-ethyl-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C2CC(=O)COC2

DOS

IR

Vibrations