Geometry & MOs

Info

ID:	281673
PubChem CID:	103914203
Reduced:	ON2C8H14 (2)
Stoich.:	AB2C8D14 (2)
Weight, g/mol:	227.163377
ΔH_f, kcal/mol:	-79.83
Dipole, Da:	4.32
IP(EA), eV:	-8.99(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(cyclopropylamino)-3-oxopropyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C1=NC=CN1C)NC(CNC(=O)OC(C)(C)C)C2CC2

DOS

IR

Vibrations