Geometry & MOs

Info

ID:	419058
PubChem CID:	135107407
Reduced:	N3O4C22H23 (1)
Stoich.:	A3B4C22D23 (1)
Weight, g/mol:	386.231791
ΔH_f, kcal/mol:	-57.54
Dipole, Da:	8.15
IP(EA), eV:	-9.48(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[8-[(3-propan-2-ylimidazol-4-yl)methyl]-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

C1CN(C[C@]([C@H]1O)(CC2=CC=CC=C2)C(=O)O)CC3=CC(=NO3)C4=CC=NC=C4

DOS

IR

Vibrations