Geometry & MOs

Info

ID:	415012
PubChem CID:	135087992
Reduced:	NO3F4C14H15 (1)
Stoich.:	AB3C4D14E15 (1)
Weight, g/mol:	337.179027
ΔH_f, kcal/mol:	-326.47
Dipole, Da:	4.12
IP(EA), eV:	-9.78(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-imidazol-1-ylphenyl)-(4-methyl-1-oxa-9-azaspiro[5.5]undec-4-en-9-yl)methanone

Drug info:

PubChemData

Smile

C1CN(C[C@@H]([C@H]1O)C(=O)O)CC2=CC(=CC(=C2)F)C(F)(F)F

DOS

IR

Vibrations