Geometry & MOs

Info

ID:	383822
PubChem CID:	134975768
Reduced:	NO3C15H27 (1)
Stoich.:	AB3C15D27 (1)
Weight, g/mol:	167.11689
ΔH_f, kcal/mol:	-186.53
Dipole, Da:	2.98
IP(EA), eV:	-9.28(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-deuteriopyrrole-1-carboxamide

Drug info:

PubChemData

Smile

CC(=O)CCC1(CCCCN1C(=O)OC(C)(C)C)C

DOS

IR

Vibrations