Geometry & MOs

Info

ID:	402385
PubChem CID:	135055786
Reduced:	N3O5C21H27 (1)
Stoich.:	A3B5C21D27 (1)
Weight, g/mol:	302.167065
ΔH_f, kcal/mol:	-123.19
Dipole, Da:	9.34
IP(EA), eV:	-9.04(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methyl-2,3,3-triphenylpropan-1-ol

Drug info:

PubChemData

Smile

CC[C@H](CC(NC(=O)OCC1=CC=CC=C1)OCC)NC2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations