Geometry & MOs

Info

ID:	155980
PubChem CID:	56368589
Reduced:	N3O4C25H31 (1)
Stoich.:	A3B4C25D31 (1)
Weight, g/mol:	378.09429
ΔH_f, kcal/mol:	-165.3
Dipole, Da:	2.41
IP(EA), eV:	-8.79(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-1-ethyl-N-[[2-(propan-2-yloxymethyl)phenyl]methyl]pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)NCCNC(=O)C2CCCN2C(=O)C3=C(C4=CC=CC=C4C=C3)O

DOS

IR

Vibrations