Geometry & MOs

Info

ID:	251159
PubChem CID:	103101822
Reduced:	O2N3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	201.147727
ΔH_f, kcal/mol:	-70.21
Dipole, Da:	5.27
IP(EA), eV:	-9.4(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-(2-amino-2-oxoethyl)-N-ethyl-3-methylbutanamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)C1=CC2=C(CCNC2)C=C1

DOS

IR

Vibrations