Geometry & MOs

Info

ID:	192580
PubChem CID:	78287434
Reduced:	NO2C7H11 (2)
Stoich.:	AB2C7D11 (2)
Weight, g/mol:	352.236208
ΔH_f, kcal/mol:	-197.24
Dipole, Da:	2.87
IP(EA), eV:	-9.44(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[bis(2-methylpropyl)amino]-2-oxoethyl] 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(NC(=C1C(C)O)C)C(=O)OCC(=O)NC(C)C

DOS

IR

Vibrations