Geometry & MOs

Info

ID:	429232
PubChem CID:	135169136
Reduced:	N2O2C7H12 (1)
Stoich.:	A2B2C7D12 (1)
Weight, g/mol:	497.33659
ΔH_f, kcal/mol:	-77.26
Dipole, Da:	2.38
IP(EA), eV:	-9.88(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-[(2-amino-6-methylpyridin-4-yl)methyl]-2-N-cyclohexyl-1-N-[(1R)-1-cyclohexylpropyl]-2-N-methyl-4-oxoazetidine-1,2-dicarboxamide

Drug info:

PubChemData

Smile

CCNC(=O)C1CC(=O)N1C

DOS

IR

Vibrations