Geometry & MOs

Info

ID:	416434
PubChem CID:	135089447
Reduced:	N2O5C16H26 (1)
Stoich.:	A2B5C16D26 (1)
Weight, g/mol:	364.189926
ΔH_f, kcal/mol:	-251.16
Dipole, Da:	4.12
IP(EA), eV:	-9.16(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-anilinopyrimidin-5-yl)-(4-methyl-1-oxa-9-azaspiro[5.5]undec-4-en-9-yl)methanone

Drug info:

PubChemData

Smile

C[C@@]1(CC2(CCN(CC2)C(=O)CN3CCCC3=O)OC[C@@H]1O)O

DOS

IR

Vibrations