Geometry & MOs

Info

ID:	418164
PubChem CID:	135103736
Reduced:	NO3C19H27 (1)
Stoich.:	AB3C19D27 (1)
Weight, g/mol:	361.19026
ΔH_f, kcal/mol:	-136.58
Dipole, Da:	6.11
IP(EA), eV:	-8.72(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-aminospiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)-2-indol-1-ylethanone

Drug info:

PubChemData

Smile

CC[C@]1(CCC[C@H]2[C@@H]1CN(C2)C(=O)C3=C(C=C(C=C3)C)OC)O

DOS

IR

Vibrations