Geometry & MOs

Info

ID:	391650
PubChem CID:	135007795
Reduced:	BrSi2N4C33H49 (1)
Stoich.:	AB2C4D33E49 (1)
Weight, g/mol:	275.131014
ΔH_f, kcal/mol:	-79.62
Dipole, Da:	2.12
IP(EA), eV:	-7.14(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,5-dimethyl-2-phenylpyrrol-3-yl)-phenylmethanone

Drug info:

PubChemData

Smile

CC(C)(C)N1C=CN([Si]1(C2C3=CC=CC=C3C4=CC=CC=C24)[Si]5(N(C=CN5C(C)(C)C)C(C)(C)C)Br)C(C)(C)C

DOS

IR

Vibrations