Geometry & MOs

Info

ID:	366938
PubChem CID:	127321924
Reduced:	ON5C23H31 (1)
Stoich.:	AB5C23D31 (1)
Weight, g/mol:	380.209993
ΔH_f, kcal/mol:	7.19
Dipole, Da:	5.83
IP(EA), eV:	-8.84(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azaspiro[5.5]undec-9-en-2-yl-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)N2C(=C(C(=N2)C)CC(=O)N3CCCC4(C3)CCC=CC4)C)C

DOS

IR

Vibrations