Geometry & MOs

Info

ID:	320212
PubChem CID:	126658724
Reduced:	NH13C15 (2)
Stoich.:	AB13C15 (2)
Weight, g/mol:	315.288577
ΔH_f, kcal/mol:	116.0
Dipole, Da:	1.6
IP(EA), eV:	-8.55(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-(ethylamino)-3-methylbutyl] N-[6-(propan-2-ylamino)hexyl]carbamate

Drug info:

PubChemData

Smile

CN1C2=C(CCC3=CC=CC=C31)C=C(C=C2)C4=CC5=C(C=C4)N(C6=CC=CC=C6C=C5)C

DOS

IR

Vibrations