Geometry & MOs

Info

ID:	416665
PubChem CID:	135089993
Reduced:	O2N5C17H23 (1)
Stoich.:	A2B5C17D23 (1)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	-27.68
Dipole, Da:	4.67
IP(EA), eV:	-8.27(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-methyl-1-oxa-9-azaspiro[5.5]undec-4-ene-9-carbonyl)-1-(pyridin-4-ylmethyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=NN(C=C1NC(=O)CN2C[C@H]([C@@H](C2)O)CC3=CC=CC=N3)C

DOS

IR

Vibrations