Geometry & MOs

Info

ID:	148423
PubChem CID:	53788085
Reduced:	BrON2C21H27 (1)
Stoich.:	ABC2D21E27 (1)
Weight, g/mol:	328.142307
ΔH_f, kcal/mol:	4.53
Dipole, Da:	3.21
IP(EA), eV:	-8.76(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(propan-2-yloxycarbonylamino)phenyl] N-methyl-N-phenylcarbamate

Drug info:

PubChemData

Smile

C1CN(CCC1(C2=CC=CC=C2)C3=CC(=CC=C3)OCBr)CCCN

DOS

IR

Vibrations