Geometry & MOs

Info

ID:	37389
PubChem CID:	8020480
Reduced:	N3O5C16H23 (1)
Stoich.:	A3B5C16D23 (1)
Weight, g/mol:	380.20597
ΔH_f, kcal/mol:	-196.46
Dipole, Da:	3.48
IP(EA), eV:	-9.99(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-butylamino]-2-oxoethyl] (1S,2S)-2-methylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

C[C@H]1C[C@H]1C(=O)OCC(=O)NN2C(=O)C3(CCC(CC3)C)NC2=O

DOS

IR

Vibrations