Geometry & MOs

Info

ID:	258542
PubChem CID:	103154835
Reduced:	N2O3C13H18 (1)
Stoich.:	A2B3C13D18 (1)
Weight, g/mol:	290.149124
ΔH_f, kcal/mol:	-110.38
Dipole, Da:	2.23
IP(EA), eV:	-8.16(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methoxy-N-[3-methyl-4-(tetrazol-1-yl)phenyl]butanamide

Drug info:

PubChemData

Smile

COC(CC(=O)NC1=CC2=C(C=C1)OCC2)CN

DOS

IR

Vibrations