Geometry & MOs

Info

ID:	134820
PubChem CID:	51763868
Reduced:	N3O3C33H49 (1)
Stoich.:	A3B3C33D49 (1)
Weight, g/mol:	429.226371
ΔH_f, kcal/mol:	-159.99
Dipole, Da:	6.0
IP(EA), eV:	-9.34(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2-(tert-butylamino)-1-(furan-2-yl)-2-oxoethyl]-N-hexyl-3-nitrobenzamide

Drug info:

PubChemData

Smile

CCCCCCN([C@H](C1=C(C=C(C=C1)C)C)C(=O)NC(C)(C)CC(C)(C)C)C(=O)CNC(=O)C2=CC=CC=C2

DOS

IR

Vibrations