Geometry & MOs

Info

ID:	423387
PubChem CID:	135119406
Reduced:	N3O4C18H21 (1)
Stoich.:	A3B4C18D21 (1)
Weight, g/mol:	414.187875
ΔH_f, kcal/mol:	-68.46
Dipole, Da:	2.68
IP(EA), eV:	-8.44(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-2-[10-oxo-3-[5-(trifluoromethyl)pyridin-2-yl]-7-oxa-3,11-diazaspiro[5.6]dodecan-11-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN3C[C@@H]4COC[C@H](C3)NC4=O

DOS

IR

Vibrations