Geometry & MOs

Info

ID:	418199
PubChem CID:	135103825
Reduced:	ON2C11H18 (2)
Stoich.:	AB2C11D18 (2)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-75.73
Dipole, Da:	1.61
IP(EA), eV:	-8.62(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-5-hydroxyphenyl)-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methanone

Drug info:

PubChemData

Smile

CCC1=CN=C(N=C1N2CC[C@@H]3C[C@@H](CC[C@]3(C2)COC)N4CCOCC4)C

DOS

IR

Vibrations