Geometry & MOs

Info

ID:	275226
PubChem CID:	103814694
Reduced:	ON3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	209.152812
ΔH_f, kcal/mol:	-31.52
Dipole, Da:	6.43
IP(EA), eV:	-8.95(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-[(1-methylpyrrol-3-yl)methyl]pentanamide

Drug info:

PubChemData

Smile

CN1C=CC(=C1)CNC(=O)C2(CCCC2)N

DOS

IR

Vibrations