Geometry & MOs

Info

ID:	378961
PubChem CID:	134228567
Reduced:	N4C17H36 (1)
Stoich.:	A4B17C36 (1)
Weight, g/mol:	264.12224
ΔH_f, kcal/mol:	-37.02
Dipole, Da:	2.22
IP(EA), eV:	-8.47(2.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-hydroxy-2-methylpropyl)-4-(2-methoxyphenyl)tetrazol-5-one

Drug info:

PubChemData

Smile

CC(CCC(C)N1CCC(CC1)NC)N2CCC(CC2)N

DOS

IR

Vibrations