Geometry & MOs

Info

ID:	387106
PubChem CID:	134984021
Reduced:	NO3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	146.105528
ΔH_f, kcal/mol:	-45.27
Dipole, Da:	5.18
IP(EA), eV:	-9.91(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1Z)-3-hydroxy-N-(trimethylazaniumyl)propanimidate

Drug info:

PubChemData

Smile

CCCC[C@H](C[N+](=O)[O-])[C@](C)(C=O)C1=CC=CC=C1

DOS

IR

Vibrations