Geometry & MOs

Info

ID:	138395
PubChem CID:	52359037
Reduced:	SN3O4C18H19 (1)
Stoich.:	AB3C4D18E19 (1)
Weight, g/mol:	378.205576
ΔH_f, kcal/mol:	-79.43
Dipole, Da:	7.75
IP(EA), eV:	-9.04(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(R)-(2-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-3-(2-methylanilino)propanamide

Drug info:

PubChemData

Smile

C[C@@H](CCC1=CC=CO1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CC=CO3

DOS

IR

Vibrations