Geometry & MOs

Info

ID:	311396
PubChem CID:	126591351
Reduced:	NOS2C24H35 (1)
Stoich.:	ABC2D24E35 (1)
Weight, g/mol:	251.224915
ΔH_f, kcal/mol:	-19.7
Dipole, Da:	1.62
IP(EA), eV:	-8.76(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-5-[3-[(3S)-3-methyloxiran-2-yl]but-3-en-2-yl]non-4-en-4-amine

Drug info:

PubChemData

Smile

C/C=C\[C@@H]1CC(CC[C@@H]1C(C)(C)O)N(CCC2=CC=CS2)CCC3=CC=CS3

DOS

IR

Vibrations