Geometry & MOs

Info

ID:	198434
PubChem CID:	79101157
Reduced:	ON3C11H19 (1)
Stoich.:	AB3C11D19 (1)
Weight, g/mol:	209.152812
ΔH_f, kcal/mol:	-19.71
Dipole, Da:	4.89
IP(EA), eV:	-9.02(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylbutan-2-yl)-2-(pyrrol-1-ylamino)acetamide

Drug info:

PubChemData

Smile

CCCC(C)NC(=O)CNN1C=CC=C1

DOS

IR

Vibrations