Geometry & MOs

Info

ID:	374144
PubChem CID:	131324385
Reduced:	N2O3C11H14 (1)
Stoich.:	A2B3C11D14 (1)
Weight, g/mol:	149.095297
ΔH_f, kcal/mol:	-80.16
Dipole, Da:	5.72
IP(EA), eV:	-9.69(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-(methylaminomethyl)-1H-pyrrole-2-carbonitrile

Drug info:

PubChemData

Smile

C1COCCC1N2C=C(C=N2)C=CC(=O)O

DOS

IR

Vibrations