Geometry & MOs

Info

ID:	392317
PubChem CID:	135014442
Reduced:	N2O2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	170.154489
ΔH_f, kcal/mol:	-43.59
Dipole, Da:	5.27
IP(EA), eV:	-9.59(0.38)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(5-ethoxy-3-methyl-4-methylidenehex-5-en-2-yl)azanium

Drug info:

PubChemData

Smile

CC1(C2CCC1([C@H]3C2N4C(O3)CC(O4)(C)C#N)C)C

DOS

IR

Vibrations