Geometry & MOs

Info

ID:	85808
PubChem CID:	49879434
Reduced:	N3O3C13H17 (1)
Stoich.:	A3B3C13D17 (1)
Weight, g/mol:	149.084064
ΔH_f, kcal/mol:	-57.42
Dipole, Da:	2.96
IP(EA), eV:	-8.99(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-methoxy-3,3a-dihydro-2H-pentalen-1-imine

Drug info:

PubChemData

Smile

CCC1=C(N(N=C1C)CC2=C(ON=C2C(=O)O)C)C

DOS

IR

Vibrations