Geometry & MOs

Info

ID:	171471
PubChem CID:	75381545
Reduced:	O2N3C19H23 (1)
Stoich.:	A2B3C19D23 (1)
Weight, g/mol:	312.01095
ΔH_f, kcal/mol:	-41.38
Dipole, Da:	2.58
IP(EA), eV:	-9.49(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[2-(furan-2-yl)-2-hydroxyethyl]-1-methylpyrrole-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)(CCO)NC(=O)NCC2=CC=C(C=C2)C3=CN=CC=C3

DOS

IR

Vibrations