Geometry & MOs

Info

ID:	187763
PubChem CID:	77621290
Reduced:	FO3N8C39H53 (1)
Stoich.:	AB3C8D39E53 (1)
Weight, g/mol:	422.231791
ΔH_f, kcal/mol:	-100.39
Dipole, Da:	3.73
IP(EA), eV:	-8.44(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(3-amino-3-phenylpropyl)-3-[(4-methoxyphenyl)methyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione

Drug info:

PubChemData

Smile

CC1CN(CC(=O)N1)C(=N)N(C2CC3CC(C2C)C3(C)C)C4=CC5=C(C=C4)C(=O)N(C(=N5)CN6CCN(CC6)C)CCC7=C(C=C(C=C7)OC)F

DOS

IR

Vibrations