Geometry & MOs

Info

ID:	418648
PubChem CID:	135106499
Reduced:	OCl2N3C13H13 (1)
Stoich.:	AB2C3D13E13 (1)
Weight, g/mol:	301.204179
ΔH_f, kcal/mol:	-9.44
Dipole, Da:	4.5
IP(EA), eV:	-9.11(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethylphenyl)-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methanone

Drug info:

PubChemData

Smile

CN1C=CN=C1CCNC(=O)C2=C(C=CC=C2Cl)Cl

DOS

IR

Vibrations