Geometry & MOs

Info

ID:	306942
PubChem CID:	125264396
Reduced:	N2O4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	304.189926
ΔH_f, kcal/mol:	-118.81
Dipole, Da:	1.98
IP(EA), eV:	-8.67(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3aR,6aS)-N-(cyclopropylmethyl)-4-[(1-methylpyrazol-4-yl)methyl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H]2[C@H]([C@H](CN2CC3=CC4=C(C=C3)OCO4)N5CCOCC5)OC1

DOS

IR

Vibrations