Geometry & MOs

Info

ID:	435300
PubChem CID:	135188205
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	628.269713
ΔH_f, kcal/mol:	-105.89
Dipole, Da:	4.52
IP(EA), eV:	-9.14(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 4-[8-[(2R)-2-[(2-fluoro-5-methylbenzoyl)amino]-3-methylbutanoyl]-3-methyl-2,4-dioxo-1,3,8-triazaspiro[4.5]decan-1-yl]benzoate

Drug info:

PubChemData

Smile

CN1CN(C2(C1=O)CCCCC2)C3=CC=C(C=C3)C(=O)O

DOS

IR

Vibrations