Geometry & MOs

Info

ID:	417478
PubChem CID:	135095267
Reduced:	N5O6C27H39 (1)
Stoich.:	A5B6C27D39 (1)
Weight, g/mol:	312.220164
ΔH_f, kcal/mol:	-247.81
Dipole, Da:	7.97
IP(EA), eV:	-9.43(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5S)-4-methoxy-7-[(1-methylindol-5-yl)methyl]-7-azaspiro[4.5]decane

Drug info:

PubChemData

Smile

C[C@H]1C(=O)N2CCC[C@@H]2C(=O)N[C@H](C(=O)N[C@H](CN(CC(=O)N1)C(=O)COC)CC3=CC=CC=C3)C(C)C

DOS

IR

Vibrations