Geometry & MOs

Info

ID:	414577
PubChem CID:	135087536
Reduced:	NO2C8H12 (2)
Stoich.:	AB2C8D12 (2)
Weight, g/mol:	375.215806
ΔH_f, kcal/mol:	-142.81
Dipole, Da:	5.41
IP(EA), eV:	-8.81(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4R,5S)-9-(1-cyclopropylpyrrole-2-carbonyl)-5-hydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl]acetamide

Drug info:

PubChemData

Smile

CN(CC1COCCO1)CC(=O)NCC2=CC=CC=C2OC

DOS

IR

Vibrations