Geometry & MOs

Info

ID:	1930
PubChem CID:	5375
Reduced:	O5N7C17H23 (1)
Stoich.:	A5B7C17D23 (1)
Weight, g/mol:	405.176067
ΔH_f, kcal/mol:	-194.2
Dipole, Da:	8.17
IP(EA), eV:	-9.21(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-carbamoylpyrrolidin-1-yl)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-1-methyl-2,6-dioxo-1,3-diazinane-4-carboxamide

Drug info:

PubChemData

Smile

CN1C(=O)CC(NC1=O)C(=O)NC(CC2=CN=CN2)C(=O)N3CCCC3C(=O)N

DOS

IR

Vibrations