Geometry & MOs

Info

ID:	241000
PubChem CID:	93619191
Reduced:	N7C13H21 (1)
Stoich.:	A7B13C21 (1)
Weight, g/mol:	228.126263
ΔH_f, kcal/mol:	108.98
Dipole, Da:	10.57
IP(EA), eV:	-9.31(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-prop-2-ynylamino]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H](CN(C1)CCNC2=NN3C(=NN=N3)C=C2)C

DOS

IR

Vibrations