Geometry & MOs

Info

ID:	416612
PubChem CID:	135089826
Reduced:	SN5O6C29H45 (1)
Stoich.:	AB5C6D29E45 (1)
Weight, g/mol:	303.183444
ΔH_f, kcal/mol:	-281.52
Dipole, Da:	7.97
IP(EA), eV:	-8.57(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4R,5S)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-2-phenoxyethanone

Drug info:

PubChemData

Smile

C[C@H]1C(=O)N[C@@H](CN(CC(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCSC)C(C)C)C(=O)COC(C)C)CC2=CC=CC=C2

DOS

IR

Vibrations