Geometry & MOs

Info

ID:	281679
PubChem CID:	103914210
Reduced:	O2N4C9H16 (1)
Stoich.:	A2B4C9D16 (1)
Weight, g/mol:	243.194677
ΔH_f, kcal/mol:	-55.84
Dipole, Da:	5.86
IP(EA), eV:	-9.98(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-[[2-oxo-2-(pentan-2-ylamino)ethyl]amino]butanamide

Drug info:

PubChemData

Smile

CC1=NN=C(O1)CNC(C(C)C)C(=O)N

DOS

IR

Vibrations