Geometry & MOs

Info

ID:	374531
PubChem CID:	131331099
Reduced:	OSN2H6C10 (1)
Stoich.:	ABC2D6E10 (1)
Weight, g/mol:	174.079313
ΔH_f, kcal/mol:	47.01
Dipole, Da:	2.91
IP(EA), eV:	-9.49(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-4-formyl-1-methylpyrrole-2-carbonitrile

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC(=C2S1)C(=O)C#N

DOS

IR

Vibrations