Geometry & MOs

Info

ID:	212917
PubChem CID:	81062242
Reduced:	O3N4C13H20 (1)
Stoich.:	A3B4C13D20 (1)
Weight, g/mol:	175.132077
ΔH_f, kcal/mol:	-60.52
Dipole, Da:	3.94
IP(EA), eV:	-9.31(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-methyl-1-(2-propan-2-yloxyethyl)urea

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(=O)C1=NC=C(C=C1)/C(=N/O)/N

DOS

IR

Vibrations