Geometry & MOs

Info

ID:	382850
PubChem CID:	134974239
Reduced:	N3O5C6H11 (1)
Stoich.:	A3B5C6D11 (1)
Weight, g/mol:	348.220164
ΔH_f, kcal/mol:	-49.4
Dipole, Da:	5.24
IP(EA), eV:	-9.81(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]-1-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)methanimine

Drug info:

PubChemData

Smile

C1COCCN1C(C[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations