Geometry & MOs

Info

ID:	390643
PubChem CID:	135000121
Reduced:	N2Si3C35H46 (1)
Stoich.:	A2B3C35D46 (1)
Weight, g/mol:	263.131014
ΔH_f, kcal/mol:	25.55
Dipole, Da:	1.6
IP(EA), eV:	-7.34(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-4-(2-methylphenyl)but-3-yn-2-yl]benzamide

Drug info:

PubChemData

Smile

CCN(CC)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)[Si](C)(C=C)[Si](C3=CC=CC=C3)(C4=CC=CC=C4)N(CC)CC

DOS

IR

Vibrations