Geometry & MOs

Info

ID:	262039
PubChem CID:	103267111
Reduced:	NO3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	155.105862
ΔH_f, kcal/mol:	-37.1
Dipole, Da:	4.81
IP(EA), eV:	-9.51(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-(but-3-yn-2-ylamino)propanamide

Drug info:

PubChemData

Smile

CC(C#C)NCC1=C(C2=CC=CC=C2O1)C(=O)O

DOS

IR

Vibrations