Geometry & MOs

Info

ID:	199721
PubChem CID:	79287373
Reduced:	O2N3C15H19 (1)
Stoich.:	A2B3C15D19 (1)
Weight, g/mol:	212.116092
ΔH_f, kcal/mol:	-33.97
Dipole, Da:	5.58
IP(EA), eV:	-8.76(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-methyl-2-[[2-(prop-2-ynylamino)acetyl]amino]propanoate

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=CC=CC(=C1)NC(=O)CNCC#C

DOS

IR

Vibrations