Geometry & MOs

Info

ID:	198417
PubChem CID:	79098593
Reduced:	NC4H6 (4)
Stoich.:	AB4C6 (4)
Weight, g/mol:	236.152478
ΔH_f, kcal/mol:	59.69
Dipole, Da:	3.56
IP(EA), eV:	-8.74(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylpropyl)-2-(3-propanoylpyrrol-1-yl)acetamide

Drug info:

PubChemData

Smile

CCCNC(C)C1=CN(C=C1)CC2=CN=CN2C3CC3

DOS

IR

Vibrations