Geometry & MOs

Info

ID:	422782
PubChem CID:	135118400
Reduced:	N3O3C20H25 (1)
Stoich.:	A3B3C20D25 (1)
Weight, g/mol:	312.168522
ΔH_f, kcal/mol:	-50.23
Dipole, Da:	4.49
IP(EA), eV:	-8.77(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S,4S)-3,4-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCC1)NC(=O)C2=C(ON=C2N3CCCC3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations