Geometry & MOs

Info

ID:	49384
PubChem CID:	11532953
Reduced:	O2N6C27H32 (1)
Stoich.:	A2B6C27D32 (1)
Weight, g/mol:	472.214427
ΔH_f, kcal/mol:	-2.51
Dipole, Da:	4.07
IP(EA), eV:	-8.54(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]ethyl]-4-[(4-methoxyphenyl)sulfonyl-methylamino]-N-methylbutanamide

Drug info:

PubChemData

Smile

C[C@@H]1CCCN1C2=NC(=CC(=N2)N3CCN(C[C@H]3C)C4=NC=C(C=C4C)C(=O)O)C5=CC=CC=C5

DOS

IR

Vibrations