Geometry & MOs

Info

ID:	252499
PubChem CID:	103111791
Reduced:	O2N4C11H14 (1)
Stoich.:	A2B4C11D14 (1)
Weight, g/mol:	270.132805
ΔH_f, kcal/mol:	34.19
Dipole, Da:	5.51
IP(EA), eV:	-9.31(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxyethyl 1-(2-acetamidoethyl)-5-methyltriazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])CNC2=NCCN2

DOS

IR

Vibrations