Geometry & MOs

Info

ID:	201916
PubChem CID:	79604479
Reduced:	N2O4C9H16 (1)
Stoich.:	A2B4C9D16 (1)
Weight, g/mol:	248.225249
ΔH_f, kcal/mol:	-117.3
Dipole, Da:	2.45
IP(EA), eV:	-10.25(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethyl-2,5-dimethylpyrrol-3-yl)methyl]-2,3-dimethylcyclopentan-1-amine

Drug info:

PubChemData

Smile

CC(C1=NOC(=N1)CC(COC)O)OC

DOS

IR

Vibrations