Geometry & MOs

Info

ID:	274777
PubChem CID:	103811588
Reduced:	O2N3C14H17 (1)
Stoich.:	A2B3C14D17 (1)
Weight, g/mol:	223.132077
ΔH_f, kcal/mol:	-36.23
Dipole, Da:	3.45
IP(EA), eV:	-9.41(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]cyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CN=C(O1)CNC(=O)C(CN)C2=CC=CC=C2

DOS

IR

Vibrations