Geometry & MOs

Info

ID:	208376
PubChem CID:	80526812
Reduced:	SN2C18H32 (1)
Stoich.:	AB2C18D32 (1)
Weight, g/mol:	366.04015
ΔH_f, kcal/mol:	-12.06
Dipole, Da:	2.98
IP(EA), eV:	-8.41(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-1-cyclopropyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CCCNC1CCN(C(C1C)C)CC(C)(C)C2=CC=CS2

DOS

IR

Vibrations