Geometry & MOs

Info

ID:	271007
PubChem CID:	103639996
Reduced:	NOC8H14 (2)
Stoich.:	ABC8D14 (2)
Weight, g/mol:	329.11028
ΔH_f, kcal/mol:	-74.05
Dipole, Da:	2.82
IP(EA), eV:	-8.05(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[2-[butan-2-yl(methyl)amino]ethyl]-1-ethylpyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CCC(C)N(C)CCNCC1=C(C=CC(=C1)OC)OC

DOS

IR

Vibrations