Geometry & MOs

Info

ID:	423821
PubChem CID:	135120366
Reduced:	NOC10H13 (2)
Stoich.:	ABC10D13 (2)
Weight, g/mol:	262.179361
ΔH_f, kcal/mol:	-72.14
Dipole, Da:	2.78
IP(EA), eV:	-9.28(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4R,5S)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCC(C)(C)C(=O)N[C@@H]1COC[C@H]1CC2=CC=NC3=CC=CC=C23

DOS

IR

Vibrations