Geometry & MOs

Info

ID:	282302
PubChem CID:	103921865
Reduced:	N2O2C17H24 (1)
Stoich.:	A2B2C17D24 (1)
Weight, g/mol:	235.168462
ΔH_f, kcal/mol:	-32.66
Dipole, Da:	4.16
IP(EA), eV:	-9.1(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-dimethyl-3-[3-[(propan-2-ylamino)methyl]phenyl]urea

Drug info:

PubChemData

Smile

CCOC1CC(C1(C)C)NCC2=CC(=CC=C2)OCC#N

DOS

IR

Vibrations