Geometry & MOs

Info

ID:	278940
PubChem CID:	103840007
Reduced:	O2N5C11H21 (1)
Stoich.:	A2B5C11D21 (1)
Weight, g/mol:	281.173942
ΔH_f, kcal/mol:	-54.91
Dipole, Da:	4.34
IP(EA), eV:	-8.86(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-acetyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-1-methylpyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)CCN1C=NC=N1)(CN(C)C)O

DOS

IR

Vibrations