Geometry & MOs

Info

ID:	41823
PubChem CID:	8147180
Reduced:	NO7C19H28 (1)
Stoich.:	AB7C19D28 (1)
Weight, g/mol:	376.17467
ΔH_f, kcal/mol:	-256.24
Dipole, Da:	3.77
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.754573
Charge, e:	0

Chem-info

IUPAC name:

2-[(4R)-4-methyl-4-(4-nitrophenyl)-2,5-dioxoimidazolidin-1-yl]-N,N-di(propan-2-yl)acetamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C(=O)OC)OC[C@@H](C[NH+]2CCC(CC2)C(=O)OC)O

DOS

IR

Vibrations