Geometry & MOs

Info

ID:	392817
PubChem CID:	135018046
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	373.200156
ΔH_f, kcal/mol:	-177.23
Dipole, Da:	2.27
IP(EA), eV:	-9.51(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[(3aR,6aS)-5-benzyl-2-methyl-1,3-dioxo-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrrol-4-yl]methyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC[C@H]1[C@H]2[C@@H](CN1CC3=CC=CC=C3)C(=O)N(C2=O)C

DOS

IR

Vibrations