Geometry & MOs

Info

ID:	149379
PubChem CID:	53789051
Reduced:	NOSiC6H14 (1)
Stoich.:	ABCD6E14 (1)
Weight, g/mol:	785.397413
ΔH_f, kcal/mol:	14.64
Dipole, Da:	2.77
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.214469
Charge, e:	0

Chem-info

IUPAC name:

butyl 4-bis(4-methoxy-3,5-dimethylphenyl)phosphanyl-2-[bis(4-methoxy-3,5-dimethylphenyl)phosphanylmethyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(CN=O)[Si](C)C

DOS

IR

Vibrations