Geometry & MOs

Info

ID:	393040
PubChem CID:	135019085
Reduced:	O3N5C18H19 (1)
Stoich.:	A3B5C18D19 (1)
Weight, g/mol:	194.167065
ΔH_f, kcal/mol:	-60.63
Dipole, Da:	6.87
IP(EA), eV:	-9.18(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R,10R)-4-ethyl-10-methoxyspiro[4.5]dec-3-ene

Drug info:

PubChemData

Smile

CCCNC(=O)C1=CC=C(C=C1)CN2C=C3C(=C2C(=O)O)N=CN=C3N

DOS

IR

Vibrations